Geometry & MOs

Info

ID:	169818
PubChem CID:	75154489
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	288.077993
ΔH_f, kcal/mol:	-39.3
Dipole, Da:	1.67
IP(EA), eV:	-9.41(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-3-(1-ethyl-2,5-dioxopyrrolidin-3-yl)sulfanylpropanoic acid

Drug info:

PubChemData

Smile

CC1CCC(CC1OO)C(=C)C

DOS

IR

Vibrations